UCSF

ZINC19994893

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 25 No

Popular Name: (5E)-1-cyclohexyl-5-[(2-morpholinoethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione (5E)-1-cyclohexyl-5-[(2-morpholi…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.66 4.32 -10.36 2 7 0 79 366.487 5 ↓
Mid Mid (pH 6-8) 0.66 6.59 -55.92 3 7 1 81 367.495 5 ↓
Mid Mid (pH 6-8) 0.66 6.59 -54.71 3 7 1 81 367.495 5 ↓

Activity (Go SEA)

Rings

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.